Hydrogen 3-(2-carboxylatoethyl)-2-[3-[3-(2-carboxylatoethyl)-3H-benzoxazol-2-ylidene]prop-1-enyl]benzoxazolium

Catalog Number

ACM68133971

Product Name

Hydrogen 3-(2-carboxylatoethyl)-2-[3-[3-(2-carboxylatoethyl)-3H-benzoxazol-2-ylidene]prop-1-enyl]benzoxazolium

CAS

68133-97-1

Category

Heterocyclic Organic Compound

Synonyms

EINECS 268-719-4, CID6437475, Anhydro-3,3-bis(beta-carboxyethyl)-2,2-oxacarbocyanine hydroxide, 68133-97-1, Benzoxazolium, 3-(2-carboxyethyl)-2-(3-(3-(2-carboxyethyl)-2(3H)-benzoxazolylidene)-1-propen-1-yl)-, inner salt, Benzoxazolium, 3-(2-carboxyethyl)-2-(3-(3-(2-carboxyethyl)-2(3H)-benzoxazolylidene)-1-propenyl)-, inner salt, Hydrogen 3-(2-carboxylatoethyl)-2-(3-(3-(2-carboxylatoethyl)-3H-benzoxazol-2-ylidene)prop-1-enyl)benzoxazolium

IUPAC Name

3-[2-[(E)-3-[3-(3-oxido-3-oxopropyl)-1,3-benzoxazol-3-ium-2-yl]prop-2-enyl]-1,3-benzoxazol-3-ium-3-yl]propanoate

Molecular Weight

420.414700 [g/mol]

Molecular Formula

C₂₃H₂₀N₂O₆

Canonical SMILES

C1=CC=C2C(=C1)N(C(=CC=CC3=[N+](C4=CC=CC=C4O3)CCC(=O)O)O2)CCC(=O)[O-]

InChI Key

GPBWNDALNYVHLP-BJMVGYQFSA-N

EC Number

268-719-4

Exact Mass

420.13200

H-Bond Acceptor

6

H-Bond Donor

0

MSDS

COA

Spec Sheet